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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	C5a anaphylatoxin chemotactic receptor 1
Species	Homo sapiens (Human)
Gene	C5AR1
Synonym	complement component 5a receptor 1 complement C5a receptor C5A CD88 C5R1 C5aR1 C5AR C5a1 receptor C5a anaphylatoxin chemotactic receptor C5a-R [ Show all ]
Disease	Vasculitis Atopic dermatitis Inflammatory disease Rheumatoid arthritis
Length	350
Amino acid sequence	MDSFNYTTPDYGHYDDKDTLDLNTPVDKTSNTLRVPDILALVIFAVVFLVGVLGNALVVWVTAFEAKRTINAIWFLNLAVADFLSCLALPILFTSIVQHHHWPFGGAACSILPSLILLNMYASILLLATISADRFLLVFKPIWCQNFRGAGLAWIACAVAWGLALLLTIPSFLYRVVREEYFPPKVLCGVDYSHDKRRERAVAIVRLVLGFLWPLLTLTICYTFILLRTWSRRATRSTKTLKVVVAVVASFFIFWLPYQVTGIMMSFLEPSSPTFLLLKKLDSLCVSFAYINCCINPIIYVVAGQGFQGRLRKSLPSLLRNVLTEESVVRESKSFTRSTVDTMAQKTQAV
UniProt	P21730
Protein Data Bank	6c1r, 6c1q, 5o9h
GPCR-HGmod model	P21730
3D structure model	This structure is from PDB ID 6c1r.
BioLiP	BL0415511, BL0415514, BL0415513, BL0415512, BL0401194,BL0401195,BL0401196,
Therapeutic Target Database	T15439
ChEMBL	CHEMBL2373
IUPHAR	32
DrugBank	N/A

Ligand

Name	BDBM50290485
Molecular formula	C29H36N6O4
IUPAC name	2-[3-[4-hydroxy-3-[(2R)-3-(4-hydroxyphenyl)-1-oxo-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropan-2-yl]-2-oxo-1H-imidazol-5-yl]propyl]guanidine
Molecular weight	532.645
Hydrogen bond acceptor	5
Hydrogen bond donor	5
XlogP	2.2
Synonyms	5-[3-amino(imino)methylaminopropyl]-3-[1-(4-hydroxybenzyl)-2-oxo-2-spiro[2,3-dihydro-1H-indene-1,4''-(hexahydropyridine)]-1-yl-(1R)-ethyl]-(5R)-tetrahydro-1H-2,4-imidazoledione
Inchi Key	BKRPHWPSTZZSOG-XMMPIXPASA-N
Inchi ID	InChI=1S/C29H36N6O4/c30-27(31)32-15-3-6-23-25(37)35(28(39)33-23)24(18-19-7-9-21(36)10-8-19)26(38)34-16-13-29(14-17-34)12-11-20-4-1-2-5-22(20)29/h1-2,4-5,7-10,24,36-37H,3,6,11-18H2,(H,33,39)(H4,30,31,32)/t24-/m1/s1
PubChem CID	91934582
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50290485
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
IC50	4000.0 nM	N/A	BindingDB

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